Yoon S. Lee, Walter C. Ermler, et al.
The Journal of Chemical Physics
MCSCF calculations followed by large scale configuration interaction, comparable with the best done for isovalent methylene, give a singlet-triplet splitting in silylene of 21.0±1 kcal/mol. The singlet is the lower energy state. Structural parameters for the as yet unobserved triplet are r e=1.48±0.005 Å and θe=118. 5±1°. © 1986 American Institute of Physics.
Yoon S. Lee, Walter C. Ermler, et al.
The Journal of Chemical Physics
D.J. Defrees, A.D. McLean
Chemical Physics Letters
A.D. McLean, G.S. Chandler
The Journal of Chemical Physics
Yoon Sup Lee, Kyoung Koo Baeck, et al.
Journal of Computational Chemistry